3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]prop-2-enamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]prop-2-enamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]prop-2-enamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]prop-2-enamide Traditional Name: 3-(3,4-dimethoxyphenyl)-N-(homoveratrylthiocarbamoyl)acrylamide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC(=O)C=CC2=CC(=C(C=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC(=O)C=CC2=CC(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C22H26N2O5S/c1-26-17-8-5-15(13-19(17)28-3)7-10-21(25)24-22(30)23-12-11-16-6-9-18(27-2)20(14-16)29-4/h5-10,13-14H,11-12H2,1-4H3,(H2,23,24,25,30)